CID 4095651

2-(3-methoxy-4-(2-methoxyethoxy)phenyl)-1h-imidazo(4,5-b)phenazine

Structural Information

Molecular Formula
C23H20N4O3
SMILES
COCCOC1=C(C=C(C=C1)C2=NC3=CC4=NC5=CC=CC=C5NC4=CC3=N2)OC
InChI
InChI=1S/C23H20N4O3/c1-28-9-10-30-21-8-7-14(11-22(21)29-2)23-26-19-12-17-18(13-20(19)27-23)25-16-6-4-3-5-15(16)24-17/h3-8,11-13,24H,9-10H2,1-2H3
InChIKey
YMXHTQSROASJFL-UHFFFAOYSA-N
Compound name
2-[3-methoxy-4-(2-methoxyethoxy)phenyl]-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.15353 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.16081 197.3
[M+Na]+ 423.14275 208.8
[M-H]- 399.14625 201.4
[M+NH4]+ 418.18735 206.8
[M+K]+ 439.11669 201.0
[M+H-H2O]+ 383.15079 185.3
[M+HCOO]- 445.15173 214.2
[M+CH3COO]- 459.16738 206.5
[M+Na-2H]- 421.12820 203.9
[M]+ 400.15298 204.8
[M]- 400.15408 204.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.